#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzr s SER 2 N 0.00 -0.22 -0.10 1.61 0.01 -1.26 -4.94 113.70 108.81 2dzr s SER 2 Ca 0.00 0.45 0.01 0.00 1.31 0.00 0.00 55.95 57.72 2dzr s SER 2 Cb 0.00 0.34 -0.02 0.00 0.21 0.00 0.00 66.02 66.55 2dzr s SER 2 CO 0.00 -0.16 -0.12 -0.55 0.41 0.00 0.00 173.24 172.82 2dzr s SER 3 N 1.23 4.15 0.00 2.44 0.15 -1.26 -4.81 113.70 115.61 2dzr s SER 3 Ca -0.09 -0.24 0.00 0.00 0.70 0.00 0.00 55.95 56.32 2dzr s SER 3 Cb -0.11 -1.34 0.00 0.00 -1.71 0.00 0.00 66.02 62.87 2dzr s SER 3 CO -0.08 0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.22 2dzr n GLY 4 N 3.00 0.19 2.20 9.45 0.00 -1.26 -5.10 105.19 113.67 2dzr n GLY 4 Ca -0.18 0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2dzr n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dzr n SER 5 N 0.00 -9.20 0.00 1.61 7.64 -1.26 -5.09 113.62 107.32 2dzr n SER 5 Ca 0.00 1.61 0.00 0.00 1.01 0.00 0.00 58.87 61.49 2dzr n SER 5 Cb 0.00 -5.10 0.00 0.00 -1.01 0.00 0.00 64.21 58.10 2dzr n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dzr n SER 6 N 1.85 0.00 -0.15 6.43 7.64 -1.26 -5.14 113.62 122.99 2dzr n SER 6 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2dzr n SER 6 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2dzr n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dzr n GLY 7 N 0.00 0.17 0.00 0.23 0.00 -1.26 -4.63 105.19 99.70 2dzr n GLY 7 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.12 2dzr n GLY 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dzr n LEU 8 N 0.00 0.00 -0.32 0.99 4.77 -1.26 0.29 117.00 121.47 2dzr n LEU 8 Ca 0.00 0.98 0.17 0.00 -0.03 0.00 0.00 56.01 57.13 2dzr n LEU 8 Cb 0.00 -0.48 0.32 0.00 -2.33 0.00 0.00 43.42 40.93 2dzr n LEU 8 CO 0.00 -0.48 0.79 -1.14 -1.33 0.00 0.00 177.39 175.23 2dzr n ARG 9 N -2.80 -0.07 -0.10 3.23 0.63 -1.26 0.18 116.66 116.48 2dzr n ARG 9 Ca 0.00 1.40 -0.09 0.00 -0.92 0.00 0.00 57.85 58.24 2dzr n ARG 9 Cb 0.00 -2.26 -0.01 0.00 0.45 0.00 0.00 32.46 30.63 2dzr n ARG 9 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2dzr h GLU 10 N 0.00 0.43 0.21 -0.14 4.39 -0.77 0.36 114.58 119.07 2dzr h GLU 10 Ca 0.61 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 60.28 2dzr h GLU 10 Cb 1.33 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.86 2dzr h GLU 10 CO -0.86 0.30 -0.37 1.96 -1.16 0.00 0.00 179.01 178.88 2dzr h GLN 11 N 0.43 -0.60 -0.35 2.33 4.20 0.66 0.56 115.11 122.33 2dzr h GLN 11 Ca 0.12 0.04 0.06 0.00 0.06 0.00 0.00 58.65 58.93 2dzr h GLN 11 Cb -0.03 0.14 -0.05 0.00 0.30 0.00 0.00 27.48 27.84 2dzr h GLN 11 CO -0.02 -0.40 0.03 0.28 -0.67 0.00 0.00 178.83 178.04 2dzr h VAL 12 N -0.63 0.77 -0.81 -0.54 2.07 -1.19 0.85 116.25 116.78 2dzr h VAL 12 Ca -0.02 -0.04 0.23 0.00 0.82 0.00 0.00 66.70 67.69 2dzr h VAL 12 Cb 0.58 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 2dzr h VAL 12 CO -0.13 0.02 0.68 1.56 0.02 0.00 0.00 177.57 179.72 2dzr h GLN 13 N 0.13 0.00 0.10 1.57 4.20 0.15 0.22 115.11 121.48 2dzr h GLN 13 Ca 0.17 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.51 2dzr h GLN 13 Cb 0.22 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.97 2dzr h GLN 13 CO -0.26 0.00 -2.04 -3.47 -0.67 0.00 0.00 178.83 172.39 2dzr n ASP 14 N -3.95 2.09 0.00 1.46 2.03 0.63 -3.60 116.55 115.22 2dzr n ASP 14 Ca 0.17 0.17 0.00 0.00 0.52 0.00 0.00 54.79 55.65 2dzr n ASP 14 Cb 0.97 -0.81 0.00 0.00 -0.72 0.00 0.00 41.12 40.56 2dzr n ASP 14 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2dzr n LEU 15 N -3.51 0.00 -0.31 -2.67 7.94 0.26 0.19 117.00 118.90 2dzr n LEU 15 Ca -0.34 0.92 0.12 0.00 -1.11 0.00 0.00 56.01 55.60 2dzr n LEU 15 Cb 1.02 -0.42 0.30 0.00 0.53 0.00 0.00 43.42 44.85 2dzr n LEU 15 CO 0.39 -0.42 1.08 -0.26 -1.11 0.00 0.00 177.39 177.07 2dzr h PHE 16 N 0.00 0.75 -0.94 1.96 0.04 -1.55 0.93 116.94 118.13 2dzr h PHE 16 Ca 0.00 0.04 0.01 0.00 2.80 0.00 0.00 57.97 60.82 2dzr h PHE 16 Cb 0.00 -0.19 -0.05 0.00 2.20 0.00 0.00 35.95 37.91 2dzr h PHE 16 CO -0.48 0.04 0.62 -0.91 -0.60 0.00 0.00 178.31 176.99 2dzr h ASN 17 N 0.50 1.07 0.27 2.17 4.21 -1.25 0.25 115.58 122.80 2dzr h ASN 17 Ca 0.55 -0.03 -0.01 0.00 1.21 0.00 0.00 56.30 58.02 2dzr h ASN 17 Cb 0.96 -0.27 0.00 0.00 -1.12 0.00 0.00 38.32 37.90 2dzr h ASN 17 CO -0.47 0.77 -0.13 0.50 -1.29 0.00 0.00 177.43 176.82 2dzr h LYS 18 N 1.27 -0.34 -1.00 0.81 3.64 0.70 -3.14 116.57 118.51 2dzr h LYS 18 Ca 0.35 0.02 0.31 0.00 -1.27 0.00 0.00 60.65 60.07 2dzr h LYS 18 Cb -0.13 0.08 -0.15 0.00 -0.41 0.00 0.00 32.23 31.62 2dzr h LYS 18 CO -0.08 -0.16 0.55 0.87 -2.27 0.00 0.00 179.45 178.36 2dzr h LYS 19 N -1.07 0.32 0.04 1.90 1.79 0.69 0.21 116.57 120.45 2dzr h LYS 19 Ca -0.04 -0.02 0.03 0.00 -2.18 0.00 0.00 60.65 58.44 2dzr h LYS 19 Cb 0.34 -0.07 -0.05 0.00 -1.58 0.00 0.00 32.23 30.87 2dzr h LYS 19 CO 0.06 0.21 -0.35 -0.92 -1.08 0.00 0.00 179.45 177.37 2dzr h TYR 20 N 0.33 -0.97 -1.02 -1.35 3.20 -0.54 -0.95 116.97 115.68 2dzr h TYR 20 Ca 0.72 0.03 0.29 0.00 3.14 0.00 0.00 58.73 62.91 2dzr h TYR 20 Cb 1.62 0.42 -0.13 0.00 1.54 0.00 0.00 36.73 40.18 2dzr h TYR 20 CO -0.02 -0.44 0.60 0.78 -1.64 0.00 0.00 178.16 177.43 2dzr h GLY 21 N -0.53 1.92 0.84 1.82 0.00 -0.54 0.23 103.07 106.81 2dzr h GLY 21 Ca 0.05 -0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 2dzr h GLY 21 CO -0.26 -0.36 0.01 0.83 0.00 0.00 0.00 176.54 176.77 2dzr h GLU 22 N 0.43 0.04 -0.21 4.80 5.08 -0.98 1.59 114.58 125.33 2dzr h GLU 22 Ca 0.69 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 59.10 2dzr h GLU 22 Cb 1.50 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.74 2dzr h GLU 22 CO -0.52 0.19 0.39 0.00 -1.00 0.00 0.00 179.01 178.07 2dzr h ALA 23 N 0.85 1.75 0.00 3.43 0.00 0.29 0.65 119.26 126.23 2dzr h ALA 23 Ca 0.01 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 2dzr h ALA 23 Cb 0.17 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2dzr h ALA 23 CO -0.00 -0.50 -2.13 1.28 0.00 0.00 0.00 179.25 177.89 2dzr n LEU 24 N -3.33 0.00 0.00 0.00 4.77 -0.63 -4.68 117.00 113.13 2dzr n LEU 24 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2dzr n LEU 24 Cb 0.51 0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 2dzr n LEU 24 CO 0.21 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 2dzr n GLY 25 N 1.55 1.84 3.24 -0.72 0.00 0.51 -4.98 105.19 106.63 2dzr n GLY 25 Ca -0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 2dzr n GLY 25 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2dzr n ILE 26 N -1.99 0.00 -0.05 -0.61 5.41 0.74 -4.83 119.36 118.03 2dzr n ILE 26 Ca 0.00 -0.25 -0.05 0.00 1.00 0.00 0.00 62.75 63.45 2dzr n ILE 26 Cb 0.00 -0.44 -0.06 0.00 -0.71 0.00 0.00 39.64 38.43 2dzr n ILE 26 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2dzr n LYS 27 N -0.63 1.93 -2.21 0.38 4.76 -1.26 -4.33 118.16 116.79 2dzr n LYS 27 Ca 0.02 0.01 -0.28 0.00 -2.87 0.00 0.00 58.31 55.19 2dzr n LYS 27 Cb 0.60 -1.23 0.03 0.00 -1.84 0.00 0.00 35.03 32.60 2dzr n LYS 27 CO 0.00 0.00 0.00 1.52 -1.37 0.00 0.00 177.40 177.55 2dzr s TYR 28 N -2.22 3.35 -0.35 2.13 -0.85 -1.26 -4.87 117.35 113.29 2dzr s TYR 28 Ca -0.07 0.86 -0.29 0.00 -0.52 0.00 0.00 57.07 57.04 2dzr s TYR 28 Cb 0.03 -2.78 0.00 0.00 0.38 0.00 0.00 41.96 39.59 2dzr s TYR 28 CO 0.33 -0.85 1.37 -1.25 -1.52 0.00 0.00 175.55 173.64 2dzr s PRO 29 N -5.09 3.75 0.29 -3.49 0.04 -1.26 -4.77 135.00 124.47 2dzr s PRO 29 Ca 0.54 1.13 0.02 0.00 0.04 0.00 0.00 61.00 62.73 2dzr s PRO 29 Cb -0.11 -3.96 -0.03 0.00 0.04 0.00 0.00 34.50 30.44 2dzr s PRO 29 CO 0.48 -1.34 0.46 0.08 0.04 0.00 0.00 177.00 176.72 2dzr s VAL 30 N 4.92 5.17 -0.36 -0.36 1.01 -1.25 -5.07 120.40 124.46 2dzr s VAL 30 Ca 0.60 -0.66 -0.12 0.00 0.00 0.00 0.00 61.98 61.79 2dzr s VAL 30 Cb -0.16 -3.85 0.01 0.00 0.00 0.00 0.00 36.38 32.38 2dzr s VAL 30 CO 0.28 -0.44 0.22 -1.10 0.00 0.00 0.00 175.10 174.06 2dzr s GLN 31 N -4.11 3.07 0.26 2.72 -1.52 -1.26 -4.64 119.66 114.17 2dzr s GLN 31 Ca 0.37 -0.92 -0.31 0.00 -1.95 0.00 0.00 55.36 52.55 2dzr s GLN 31 Cb -0.09 -3.77 -0.12 0.00 -0.22 0.00 0.00 33.01 28.81 2dzr s GLN 31 CO 0.33 -0.61 1.60 0.28 -0.25 0.00 0.00 175.29 176.64 2dzr n VAL 32 N 5.05 0.70 -1.81 1.09 0.31 -1.26 -4.84 118.33 117.57 2dzr n VAL 32 Ca -0.12 -0.18 -0.40 0.00 -0.01 0.00 0.00 64.34 63.63 2dzr n VAL 32 Cb 0.47 -1.87 -0.03 0.00 -0.91 0.00 0.00 33.84 31.50 2dzr n VAL 32 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2dzr n PRO 33 N 2.65 2.26 -0.26 5.55 -0.04 -1.26 -4.73 135.00 139.17 2dzr n PRO 33 Ca 0.11 -2.49 0.03 0.00 -0.04 0.00 0.00 63.50 61.11 2dzr n PRO 33 Cb 0.35 -3.31 0.16 0.00 -0.04 0.00 0.00 33.50 30.66 2dzr n PRO 33 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2dzr h TYR 34 N 7.67 0.69 0.10 0.54 0.05 -1.97 0.15 116.97 124.19 2dzr h TYR 34 Ca 0.43 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 59.24 2dzr h TYR 34 Cb 0.76 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 38.29 2dzr h TYR 34 CO 1.34 0.23 -0.18 0.87 -1.05 0.00 0.00 178.16 179.37 2dzr h LYS 35 N 0.63 -0.29 -0.99 4.88 1.79 -1.99 0.69 116.57 121.29 2dzr h LYS 35 Ca 0.38 0.02 0.21 0.00 -2.18 0.00 0.00 60.65 59.08 2dzr h LYS 35 Cb 0.44 0.07 -0.10 0.00 -1.58 0.00 0.00 32.23 31.05 2dzr h LYS 35 CO -0.29 -0.19 0.62 0.00 -1.08 0.00 0.00 179.45 178.50 2dzr h ARG 36 N -0.30 0.62 0.00 3.15 2.47 -1.84 1.18 114.38 119.67 2dzr h ARG 36 Ca -0.01 -0.04 -0.05 0.00 -1.26 0.00 0.00 59.98 58.63 2dzr h ARG 36 Cb 0.28 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.45 2dzr h ARG 36 CO -0.06 0.41 -0.22 0.82 0.56 0.00 0.00 179.97 181.48 2dzr h ILE 37 N 0.64 0.92 0.03 2.04 2.04 0.19 1.45 117.51 124.81 2dzr h ILE 37 Ca 0.56 -0.83 -0.00 0.00 1.00 0.00 0.00 64.86 65.60 2dzr h ILE 37 Cb 1.05 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 38.61 2dzr h ILE 37 CO -0.33 0.22 -0.01 0.11 0.00 0.00 0.00 178.15 178.13 2dzr h LYS 38 N 0.00 -0.03 -0.50 2.37 1.57 0.74 -3.29 116.57 117.43 2dzr h LYS 38 Ca -0.00 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 2dzr h LYS 38 Cb 0.46 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 2dzr h LYS 38 CO 0.03 0.56 0.07 0.77 -0.57 0.00 0.00 179.45 180.31 2dzr h SER 39 N -0.97 0.81 -3.57 0.86 0.02 -0.46 -3.40 113.55 106.85 2dzr h SER 39 Ca -0.00 -0.27 -0.67 0.00 -0.84 0.00 0.00 61.79 60.01 2dzr h SER 39 Cb 0.61 -0.22 -0.36 0.00 0.14 0.00 0.00 62.40 62.57 2dzr h SER 39 CO 0.01 0.88 -0.82 0.20 -1.14 0.00 0.00 176.83 175.95 2dzr s ASN 40 N -6.26 3.94 0.40 3.07 -0.87 0.50 -4.97 114.94 110.75 2dzr s ASN 40 Ca -0.13 -1.12 0.27 0.00 -1.57 0.00 0.00 52.86 50.32 2dzr s ASN 40 Cb 0.12 -1.51 0.88 0.00 -0.02 0.00 0.00 41.25 40.71 2dzr s ASN 40 CO 0.81 -0.12 1.78 1.55 -2.57 0.00 0.00 177.10 178.55 2dzr h PRO 41 N 7.84 0.00 -1.99 -0.60 0.13 -1.77 -3.28 132.00 132.34 2dzr h PRO 41 Ca -0.29 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.37 2dzr h PRO 41 Cb 1.08 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.04 2dzr h PRO 41 CO 0.52 0.00 0.33 0.41 -0.23 0.00 0.00 178.00 179.04 2dzr n GLY 42 N 0.60 4.24 0.31 1.56 0.00 -1.26 -4.39 105.19 106.24 2dzr n GLY 42 Ca 0.03 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.23 2dzr n GLY 42 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dzr n SER 43 N 0.98 0.00 -4.05 1.61 2.88 -1.24 -5.01 113.62 108.80 2dzr n SER 43 Ca 0.48 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.71 2dzr n SER 43 Cb 0.58 -0.13 -0.16 0.00 -0.75 0.00 0.00 64.21 63.75 2dzr n SER 43 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2dzr s VAL 44 N -0.57 1.85 -0.12 2.46 1.01 -1.26 -4.39 120.40 119.38 2dzr s VAL 44 Ca 0.00 -1.04 -0.22 0.00 0.00 0.00 0.00 61.98 60.71 2dzr s VAL 44 Cb 0.00 -1.82 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 2dzr s VAL 44 CO 0.00 0.29 0.67 -0.63 0.00 0.00 0.00 175.10 175.43 2dzr s ILE 45 N 1.33 5.04 -0.24 2.22 -1.09 -1.18 -4.81 121.20 122.47 2dzr s ILE 45 Ca 0.00 1.34 -0.04 0.00 -2.23 0.00 0.00 60.65 59.72 2dzr s ILE 45 Cb -0.15 -4.00 -0.00 0.00 -1.58 0.00 0.00 42.46 36.72 2dzr s ILE 45 CO -0.09 0.20 -0.02 -0.63 -1.23 0.00 0.00 174.94 173.17 2dzr s ILE 46 N 1.20 3.45 0.18 2.92 1.01 -1.26 -0.88 121.20 127.84 2dzr s ILE 46 Ca 0.34 -0.56 0.02 0.00 0.00 0.00 0.00 60.65 60.45 2dzr s ILE 46 Cb -0.17 -2.63 -0.05 0.00 0.01 0.00 0.00 42.46 39.63 2dzr s ILE 46 CO 0.15 0.34 -0.01 -1.61 0.00 0.00 0.00 174.94 173.81 2dzr s GLU 47 N 1.47 1.14 0.00 2.79 0.41 -0.06 -4.68 118.70 119.77 2dzr s GLU 47 Ca 0.05 -1.54 0.00 0.00 -0.41 0.00 0.00 54.97 53.06 2dzr s GLU 47 Cb -0.15 -0.38 0.00 0.00 -1.78 0.00 0.00 34.13 31.82 2dzr s GLU 47 CO -0.02 -0.10 0.00 0.41 -0.49 0.00 0.00 175.26 175.06 2dzr n GLY 48 N -0.26 1.07 3.27 -1.39 0.00 -1.26 0.20 105.19 106.82 2dzr n GLY 48 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 2dzr n GLY 48 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dzr n LEU 49 N 0.00 -2.02 -4.79 0.99 4.77 -1.26 -3.92 117.00 110.78 2dzr n LEU 49 Ca 0.00 0.11 -0.29 0.00 -0.03 0.00 0.00 56.01 55.80 2dzr n LEU 49 Cb 0.00 -0.99 0.13 0.00 -2.33 0.00 0.00 43.42 40.23 2dzr n LEU 49 CO 0.00 -3.63 0.71 -2.16 -1.33 0.00 0.00 177.39 170.98 2dzr s PRO 50 N -3.19 1.25 -0.10 3.23 0.04 -1.26 -4.94 135.00 130.02 2dzr s PRO 50 Ca 0.52 0.33 -0.30 0.00 0.04 0.00 0.00 61.00 61.60 2dzr s PRO 50 Cb -0.14 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.52 2dzr s PRO 50 CO 0.69 -2.13 1.24 -1.25 0.04 0.00 0.00 177.00 175.59 2dzr s PRO 51 N -5.26 4.30 0.00 0.56 0.04 -1.26 -2.50 135.00 130.87 2dzr s PRO 51 Ca 0.63 1.69 0.00 0.00 0.04 0.00 0.00 61.00 63.36 2dzr s PRO 51 Cb -0.15 -3.65 0.00 0.00 0.04 0.00 0.00 34.50 30.74 2dzr s PRO 51 CO 0.53 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 177.42 2dzr n GLY 52 N 3.49 0.20 3.02 0.56 0.00 -1.26 -5.03 105.19 106.18 2dzr n GLY 52 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2dzr n GLY 52 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dzr s ILE 53 N -2.00 2.30 1.08 -0.61 1.01 -1.04 -5.11 121.20 116.83 2dzr s ILE 53 Ca 0.00 -2.33 -0.18 0.00 0.00 0.00 0.00 60.65 58.14 2dzr s ILE 53 Cb 0.00 -2.70 0.24 0.00 0.01 0.00 0.00 42.46 40.02 2dzr s ILE 53 CO 0.00 -0.59 1.22 -2.16 0.00 0.00 0.00 174.94 173.40 2dzr s PRO 54 N 0.91 -0.27 -1.00 2.79 0.04 -1.26 -4.22 135.00 131.99 2dzr s PRO 54 Ca 0.11 -0.23 -0.22 0.00 0.04 0.00 0.00 61.00 60.69 2dzr s PRO 54 Cb -0.19 -1.72 0.07 0.00 0.04 0.00 0.00 34.50 32.69 2dzr s PRO 54 CO -0.08 -3.05 1.38 0.12 0.04 0.00 0.00 177.00 175.41 2dzr s PHE 55 N -3.45 2.66 0.37 0.56 5.36 -1.26 -4.91 117.98 117.31 2dzr s PHE 55 Ca 0.72 -0.96 -0.04 0.00 -0.96 0.00 0.00 56.93 55.68 2dzr s PHE 55 Cb -0.07 -4.61 0.02 0.00 -0.34 0.00 0.00 43.02 38.02 2dzr s PHE 55 CO 0.54 -1.84 0.56 1.03 -1.46 0.00 0.00 175.22 174.05 2dzr s ARG 56 N 4.48 2.05 0.51 10.12 1.81 -1.26 -4.99 118.95 131.67 2dzr s ARG 56 Ca 0.43 -1.74 -0.22 0.00 -1.72 0.00 0.00 55.73 52.48 2dzr s ARG 56 Cb -0.01 0.49 -0.06 0.00 -0.45 0.00 0.00 34.95 34.92 2dzr s ARG 56 CO -0.10 -0.88 1.21 0.15 -0.68 0.00 0.00 175.30 175.00 2dzr s LYS 57 N -2.74 3.45 0.04 3.54 1.02 -1.26 -4.90 119.74 118.89 2dzr s LYS 57 Ca 0.28 1.86 0.22 0.00 0.02 0.00 0.00 55.97 58.35 2dzr s LYS 57 Cb -0.02 -2.25 0.92 0.00 -0.52 0.00 0.00 37.83 35.97 2dzr s LYS 57 CO 0.20 -0.83 1.71 -0.35 -0.92 0.00 0.00 175.35 175.16 2dzr n PRO 58 N -0.88 0.04 0.28 -1.68 -0.04 -1.26 -2.41 135.00 129.05 2dzr n PRO 58 Ca 0.09 0.16 0.18 0.00 -0.04 0.00 0.00 63.50 63.89 2dzr n PRO 58 Cb 0.48 -1.56 0.75 0.00 -0.04 0.00 0.00 33.50 33.12 2dzr n PRO 58 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dzr n THR 60 N -3.03 0.00 -4.08 0.00 -2.24 -1.01 -4.91 114.28 99.01 2dzr n THR 60 Ca 0.00 -0.10 -0.31 0.00 -2.27 0.00 0.00 64.05 61.37 2dzr n THR 60 Cb 0.27 0.77 -0.07 0.00 -2.10 0.00 0.00 70.33 69.20 2dzr n THR 60 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2dzr s PHE 61 N -2.74 3.22 0.56 4.78 0.08 -0.35 -5.10 117.98 118.42 2dzr s PHE 61 Ca 0.15 0.12 -0.04 0.00 0.12 0.00 0.00 56.93 57.28 2dzr s PHE 61 Cb 0.18 -1.66 0.01 0.00 -0.57 0.00 0.00 43.02 40.97 2dzr s PHE 61 CO 0.67 0.53 0.85 0.20 -0.10 0.00 0.00 175.22 177.36 2dzr s GLY 62 N -2.13 1.60 0.29 4.36 0.00 -1.26 -4.80 107.32 105.39 2dzr s GLY 62 Ca 0.27 -0.80 -0.02 0.00 0.00 0.00 0.00 44.72 44.17 2dzr s GLY 62 CO 0.19 -0.54 1.59 1.48 0.00 0.00 0.00 173.10 175.81 2dzr h SER 63 N -0.04 -0.51 0.54 1.64 4.64 -1.98 0.40 113.55 118.24 2dzr h SER 63 Ca -0.45 0.26 -0.02 0.00 -0.47 0.00 0.00 61.79 61.11 2dzr h SER 63 Cb 1.26 0.47 -0.02 0.00 -0.31 0.00 0.00 62.40 63.80 2dzr h SER 63 CO 0.60 -0.31 -0.50 1.56 -0.87 0.00 0.00 176.83 177.31 2dzr h GLN 64 N 0.03 -0.99 -0.99 4.77 7.50 -1.99 0.62 115.11 124.07 2dzr h GLN 64 Ca 0.54 0.07 0.19 0.00 0.50 0.00 0.00 58.65 59.95 2dzr h GLN 64 Cb 1.04 0.22 -0.10 0.00 0.05 0.00 0.00 27.48 28.70 2dzr h GLN 64 CO -0.87 -0.66 0.61 -0.91 -1.50 0.00 0.00 178.83 175.50 2dzr h ASN 65 N -1.03 0.70 0.57 1.46 4.21 -1.08 -1.79 115.58 118.63 2dzr h ASN 65 Ca -0.07 0.08 -0.03 0.00 1.21 0.00 0.00 56.30 57.50 2dzr h ASN 65 Cb 0.88 -0.04 0.01 0.00 -1.12 0.00 0.00 38.32 38.04 2dzr h ASN 65 CO -0.04 0.26 -0.27 -0.07 -1.29 0.00 0.00 177.43 176.01 2dzr h LEU 66 N 0.69 -0.65 -1.53 1.61 3.38 0.61 -1.73 115.31 117.68 2dzr h LEU 66 Ca 0.56 0.02 0.48 0.00 0.09 0.00 0.00 57.88 59.02 2dzr h LEU 66 Cb 0.96 0.17 -0.09 0.00 0.09 0.00 0.00 40.66 41.79 2dzr h LEU 66 CO -0.33 -0.40 1.06 -0.62 0.09 0.00 0.00 178.44 178.24 2dzr n GLU 67 N -4.44 -0.01 0.09 1.13 1.02 0.21 0.11 120.64 118.74 2dzr n GLU 67 Ca -0.10 1.03 -0.08 0.00 -0.02 0.00 0.00 57.16 57.99 2dzr n GLU 67 Cb 0.30 -2.22 -0.05 0.00 -0.02 0.00 0.00 31.44 29.45 2dzr n GLU 67 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dzr h ARG 68 N 0.00 -0.30 -0.43 3.49 3.08 -1.03 -2.76 114.38 116.44 2dzr h ARG 68 Ca 0.82 0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.93 2dzr h ARG 68 Cb 3.01 0.07 -0.06 0.00 0.08 0.00 0.00 29.97 33.06 2dzr h ARG 68 CO -0.19 -0.02 -0.38 0.82 -1.07 0.00 0.00 179.97 179.14 2dzr h ILE 69 N -1.00 0.00 -1.04 2.04 2.04 0.16 1.51 117.51 121.23 2dzr h ILE 69 Ca -0.03 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.13 2dzr h ILE 69 Cb 0.42 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.46 2dzr h ILE 69 CO 0.05 0.00 0.75 -0.07 0.00 0.00 0.00 178.15 178.89 2dzr h LEU 70 N -0.16 0.00 0.35 1.44 3.38 -1.42 1.03 115.31 119.92 2dzr h LEU 70 Ca 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2dzr h LEU 70 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2dzr h LEU 70 CO -0.49 0.00 -0.17 0.00 0.09 0.00 0.00 178.44 177.87 2dzr h ALA 71 N 1.47 -0.47 -0.37 1.53 0.00 0.23 -2.70 119.26 118.95 2dzr h ALA 71 Ca 0.50 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 2dzr h ALA 71 Cb 2.00 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.95 2dzr h ALA 71 CO -0.01 -0.65 0.04 1.33 0.00 0.00 0.00 179.25 179.97 2dzr n VAL 72 N -5.20 1.73 -0.18 0.00 0.24 0.74 -4.36 118.33 111.29 2dzr n VAL 72 Ca -0.10 -0.87 0.30 0.00 -2.04 0.00 0.00 64.34 61.63 2dzr n VAL 72 Cb 0.26 -0.41 0.70 0.00 -1.47 0.00 0.00 33.84 32.92 2dzr n VAL 72 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dzr h ALA 73 N 3.00 2.80 -0.08 2.33 0.00 0.13 1.19 119.26 128.62 2dzr h ALA 73 Ca 0.04 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.76 2dzr h ALA 73 Cb 1.47 0.07 0.01 0.00 0.00 0.00 0.00 17.79 19.34 2dzr h ALA 73 CO 0.34 -1.29 -0.58 -0.44 0.00 0.00 0.00 179.25 177.27 2dzr h ASP 74 N 0.00 0.65 0.07 0.00 3.32 -1.82 -3.27 116.42 115.38 2dzr h ASP 74 Ca 0.45 -0.67 -0.00 0.00 0.02 0.00 0.00 57.03 56.82 2dzr h ASP 74 Cb 2.06 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 41.41 2dzr h ASP 74 CO -0.00 1.22 -0.04 0.11 -1.72 0.00 0.00 179.24 178.81 2dzr h LYS 75 N 0.14 -0.10 -6.05 3.56 1.79 0.11 -3.42 116.57 112.60 2dzr h LYS 75 Ca -0.05 0.01 -0.82 0.00 -2.18 0.00 0.00 60.65 57.61 2dzr h LYS 75 Cb 1.24 0.02 0.02 0.00 -1.58 0.00 0.00 32.23 31.93 2dzr h LYS 75 CO 0.12 -0.03 0.59 -0.89 -1.08 0.00 0.00 179.45 178.16 2dzr n ILE 76 N -5.11 0.06 -4.32 1.86 5.41 0.00 -4.27 119.36 112.99 2dzr n ILE 76 Ca -0.08 -0.01 -0.23 0.00 1.00 0.00 0.00 62.75 63.44 2dzr n ILE 76 Cb 0.08 -0.56 -0.17 0.00 -0.71 0.00 0.00 39.64 38.29 2dzr n ILE 76 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2dzr s LYS 77 N 2.32 1.26 0.10 0.38 2.20 0.53 -4.94 119.74 121.59 2dzr s LYS 77 Ca 0.99 -0.25 0.00 0.00 -0.36 0.00 0.00 55.97 56.36 2dzr s LYS 77 Cb -1.33 -1.15 -0.04 0.00 -1.51 0.00 0.00 37.83 33.80 2dzr s LYS 77 CO 0.71 -0.05 0.25 -0.06 -0.36 0.00 0.00 175.35 175.84 2dzr s PHE 78 N 0.88 3.51 -0.08 4.03 0.40 -1.25 -0.88 117.98 124.58 2dzr s PHE 78 Ca -0.11 0.23 0.04 0.00 -0.60 0.00 0.00 56.93 56.49 2dzr s PHE 78 Cb -0.15 -1.75 -0.00 0.00 0.51 0.00 0.00 43.02 41.63 2dzr s PHE 78 CO 0.01 0.55 -0.22 0.99 0.70 0.00 0.00 175.22 177.25 2dzr s THR 79 N -1.61 1.89 -0.11 0.64 2.01 -0.06 -4.85 115.64 113.56 2dzr s THR 79 Ca 0.35 -0.94 0.02 0.00 0.31 0.00 0.00 61.69 61.43 2dzr s THR 79 Cb -0.12 -1.63 0.01 0.00 0.01 0.00 0.00 72.50 70.77 2dzr s THR 79 CO 0.28 0.52 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.87 2dzr s VAL 80 N 0.19 1.63 -0.16 3.82 1.01 -1.26 -3.13 120.40 122.50 2dzr s VAL 80 Ca -0.12 -0.73 -0.15 0.00 0.00 0.00 0.00 61.98 60.98 2dzr s VAL 80 Cb -0.16 -1.47 -0.11 0.00 0.00 0.00 0.00 36.38 34.64 2dzr s VAL 80 CO 0.06 0.47 0.08 0.71 0.00 0.00 0.00 175.10 176.42 2dzr h THR 81 N 5.91 0.52 -2.92 3.92 1.35 -1.95 -3.51 112.91 116.22 2dzr h THR 81 Ca -0.30 -1.59 0.30 0.00 -0.55 0.00 0.00 66.41 64.27 2dzr h THR 81 Cb 1.19 1.18 -0.15 0.00 -1.73 0.00 0.00 68.15 68.64 2dzr h THR 81 CO 0.50 0.18 -1.00 0.54 -0.25 0.00 0.00 175.52 175.49 2dzr n ARG 82 N -4.56 -2.77 -1.59 4.72 1.74 -1.26 -4.27 116.66 108.68 2dzr n ARG 82 Ca -0.17 2.22 -0.41 0.00 -0.77 0.00 0.00 57.85 58.72 2dzr n ARG 82 Cb 0.42 -3.25 -0.03 0.00 -1.02 0.00 0.00 32.46 28.58 2dzr n ARG 82 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2dzr n PRO 83 N -3.99 2.18 -2.86 5.56 -0.04 -1.26 -4.54 135.00 130.05 2dzr n PRO 83 Ca -0.07 -2.32 -0.01 0.00 -0.04 0.00 0.00 63.50 61.06 2dzr n PRO 83 Cb 0.58 -3.19 -0.01 0.00 -0.04 0.00 0.00 33.50 30.84 2dzr n PRO 83 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2dzr n PHE 84 N 7.67 -2.65 -3.23 0.54 3.01 -1.26 -5.05 117.46 116.50 2dzr n PHE 84 Ca 0.50 1.29 0.04 0.00 1.01 0.00 0.00 57.45 60.28 2dzr n PHE 84 Cb 0.41 -2.90 -0.04 0.00 -0.01 0.00 0.00 39.48 36.94 2dzr n PHE 84 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 2dzr s GLN 85 N -1.12 0.11 -0.43 -1.08 -0.21 -1.26 -5.08 119.66 110.58 2dzr s GLN 85 Ca -0.05 0.27 0.09 0.00 0.02 0.00 0.00 55.36 55.69 2dzr s GLN 85 Cb 0.00 0.16 0.32 0.00 1.00 0.00 0.00 33.01 34.49 2dzr s GLN 85 CO 0.50 -0.06 0.73 0.41 -2.12 0.00 0.00 175.29 174.75 2dzr n GLY 86 N 4.86 3.90 2.95 3.09 0.00 -1.26 -4.89 105.19 113.83 2dzr n GLY 86 Ca -0.07 -1.94 -0.16 0.00 0.00 0.00 0.00 46.02 43.84 2dzr n GLY 86 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2dzr s LEU 87 N -2.35 1.91 0.00 0.99 -0.00 -1.26 -5.15 118.68 112.82 2dzr s LEU 87 Ca 0.41 -0.10 0.00 0.00 -0.00 0.00 0.00 54.13 54.44 2dzr s LEU 87 Cb 0.28 -0.29 -0.00 0.00 -0.00 0.00 0.00 46.19 46.17 2dzr s LEU 87 CO -0.09 0.05 -0.02 -0.63 -0.00 0.00 0.00 176.35 175.66 2dzr s ILE 88 N 0.02 0.11 0.32 1.48 1.09 -1.26 -5.05 121.20 117.90 2dzr s ILE 88 Ca 0.00 -0.18 -0.28 0.00 -1.10 0.00 0.00 60.65 59.10 2dzr s ILE 88 Cb -0.04 -0.12 -0.09 0.00 -1.06 0.00 0.00 42.46 41.15 2dzr s ILE 88 CO -0.00 -0.05 1.07 -2.16 -0.10 0.00 0.00 174.94 173.70 2dzr s PRO 89 N -0.24 4.50 -0.30 2.79 0.04 -1.26 -4.23 135.00 136.30 2dzr s PRO 89 Ca -0.02 1.69 -0.25 0.00 0.04 0.00 0.00 61.00 62.46 2dzr s PRO 89 Cb -0.02 -2.98 0.04 0.00 0.04 0.00 0.00 34.50 31.58 2dzr s PRO 89 CO -0.00 0.12 0.43 1.17 0.04 0.00 0.00 177.00 178.76 2dzr n LYS 90 N 0.80 -1.40 -1.14 4.56 4.81 -1.26 -4.66 118.16 119.87 2dzr n LYS 90 Ca 0.01 1.24 -0.34 0.00 -0.87 0.00 0.00 58.31 58.34 2dzr n LYS 90 Cb 0.46 -1.79 -0.03 0.00 0.02 0.00 0.00 35.03 33.70 2dzr n LYS 90 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2dzr n PRO 91 N 0.32 2.55 -3.64 1.64 -0.04 -1.26 -4.71 135.00 129.86 2dzr n PRO 91 Ca -0.05 -1.92 -0.08 0.00 -0.04 0.00 0.00 63.50 61.40 2dzr n PRO 91 Cb 0.61 -2.77 -0.07 0.00 -0.04 0.00 0.00 33.50 31.23 2dzr n PRO 91 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2dzr s ASP 92 N 3.33 -0.47 0.18 3.54 -1.08 -1.26 -5.18 116.67 115.73 2dzr s ASP 92 Ca 0.52 0.87 -0.18 0.00 -0.52 0.00 0.00 52.55 53.25 2dzr s ASP 92 Cb 0.14 0.93 0.03 0.00 -1.46 0.00 0.00 42.92 42.56 2dzr s ASP 92 CO -0.02 -0.15 0.52 -0.70 0.52 0.00 0.00 175.17 175.34 2dzr s GLU 93 N 0.40 1.33 -0.23 4.34 2.56 -1.26 -5.17 118.70 120.66 2dzr s GLU 93 Ca 0.01 -0.79 -0.27 0.00 0.00 0.00 0.00 54.97 53.93 2dzr s GLU 93 Cb -0.05 0.53 0.11 0.00 2.00 0.00 0.00 34.13 36.72 2dzr s GLU 93 CO -0.08 -0.56 0.94 -1.12 -0.56 0.00 0.00 175.26 173.88 2dzr s SER 94 N -2.85 -0.50 0.28 -1.70 0.01 -1.26 -5.19 113.70 102.49 2dzr s SER 94 Ca 0.07 0.86 -0.10 0.00 1.31 0.00 0.00 55.95 58.09 2dzr s SER 94 Cb -0.01 0.83 0.04 0.00 0.21 0.00 0.00 66.02 67.09 2dzr s SER 94 CO -0.05 -0.25 0.55 0.61 0.41 0.00 0.00 173.24 174.51 2dzr n GLY 95 N 1.87 1.36 3.79 3.44 0.00 -1.26 -5.17 105.19 109.23 2dzr n GLY 95 Ca -0.13 -1.22 -0.29 0.00 0.00 0.00 0.00 46.02 44.38 2dzr n GLY 95 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dzr s PRO 96 N -2.11 1.44 -0.25 1.61 0.04 -1.26 -5.08 135.00 129.40 2dzr s PRO 96 Ca 0.12 0.40 -0.02 0.00 0.04 0.00 0.00 61.00 61.54 2dzr s PRO 96 Cb -0.03 -1.86 0.13 0.00 0.04 0.00 0.00 34.50 32.78 2dzr s PRO 96 CO 0.09 -2.01 0.37 -1.54 0.04 0.00 0.00 177.00 173.94 2dzr s SER 97 N -3.99 0.42 0.16 6.66 1.04 -1.26 -5.15 113.70 111.58 2dzr s SER 97 Ca 0.63 0.05 -0.04 0.00 0.48 0.00 0.00 55.95 57.08 2dzr s SER 97 Cb -0.15 1.03 -0.03 0.00 0.10 0.00 0.00 66.02 66.98 2dzr s SER 97 CO 0.54 -0.31 0.16 -0.94 0.98 0.00 0.00 173.24 173.66 2dzr s SER 98 N 2.52 0.18 0.00 7.02 1.04 -1.26 -5.34 113.70 117.85 2dzr s SER 98 Ca 0.12 -1.15 0.00 0.00 0.48 0.00 0.00 55.95 55.39 2dzr s SER 98 Cb -0.15 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.34 2dzr s SER 98 CO -0.19 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 173.82